SCHEMBL2928067

SCHEMBL2928067

CCCCCc1cc(C)nc2c(-c3sc(N4CCOCC4)nc3Cl)c(C)nn12

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 5/20 0.50
CRHR2 Q13324 1/20 0.50
KMT2A Q03164 3/20 0.44
POLB P06746 1/20 0.44
MEN1 O00255 1/20 0.43
HSD17B10 Q99714 4/20 0.41
LMNA P02545 2/20 0.41
MAPK1 P28482 2/20 0.41
ALDH1A1 P00352 4/20 0.38
HPGD P15428 3/20 0.38
USP2 O75604 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
GAA P10253 1/20 0.36
KDM4E B2RXH2 2/20 0.36
NPY1R P25929 3/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2236292 0.99 CRHR1 (0.49) CRHR1CRHR2KMT2APOLBMEN1
SCHEMBL29256009 0.85 CRHR1 (0.54) CRHR1CRHR2KMT2APOLBMEN1
SCHEMBL2180543 0.82 CRHR1 (0.54) CRHR1CRHR2KMT2APOLBMEN1
SCHEMBL2182127 0.81 CRHR1 (0.61) CRHR1CRHR2KMT2APOLBMEN1
SCHEMBL22958804 0.81 CRHR1 (0.56) CRHR1CRHR2KMT2APOLBMEN1
SCHEMBL27051835 0.80 CRHR1 (0.50) CRHR1CRHR2KMT2APOLBMEN1
SCHEMBL29430976 0.77 CRHR1 (0.57) CRHR1CRHR2KMT2APOLBMEN1
SCHEMBL25490371 0.74 CRHR1 (0.56) CRHR1CRHR2KMT2APOLBMEN1
SCHEMBL2931339 0.72 CRHR1 (0.52) CRHR1CRHR2KMT2APOLBMEN1
SCHEMBL25490375 0.72 CRHR1 (0.49) CRHR1CRHR2KMT2APOLBMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2094709-B1 THIAZOLE PYRAZOLOPYRIMIDINES AS CRF1 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2010-09-15 EP disclosed